| SpectraBase Compound ID | KoZYv06jrnp |
|---|---|
| InChI | InChI=1S/C10H17NO/c1-8-5-9(12)7-11(6-8)10(2,3)4/h5H,6-7H2,1-4H3 |
| InChIKey | KNERKISJHYBTQY-UHFFFAOYSA-N |
| Mol Weight | 167.25 g/mol |
| Molecular Formula | C10H17NO |
| Exact Mass | 167.131014 g/mol |
Vapor Phase (Gas) Infrared Spectrum
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| SpectraBase Spectrum ID | ACwHmeS6s87 |
|---|---|
| Name | Azacyclohex-3-en-5-one, 1-tert-butyl-3-methyl- |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 167.131014170 u |
| Formula | C10H17NO |
| InChI | InChI=1S/C10H17NO/c1-8-5-9(12)7-11(6-8)10(2,3)4/h5H,6-7H2,1-4H3 |
| InChIKey | KNERKISJHYBTQY-UHFFFAOYSA-N |
| Molecular Weight | 167.252 g/mol |
| SMILES | CC(N1CC(C)=CC(=O)C1)(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.821487 |